ChemSpider 2D Image | (3Z,17alpha)-3-(Methoxyimino)-19-norpregn-4-en-20-yn-17-ol | C21H29NO2

(3Z,17α)-3-(Methoxyimino)-19-norpregn-4-en-20-yn-17-ol

  • Molecular FormulaC21H29NO2
  • Average mass327.461 Da
  • Monoisotopic mass327.219818 Da
  • ChemSpider ID21251779

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 6 of 6 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(3Z,17α)-3-(Methoxyimino)-19-norpregn-4-en-20-in-17-ol [German] [ACD/IUPAC Name]
(3Z,17α)-3-(Methoxyimino)-19-norpregn-4-en-20-yn-17-ol [ACD/IUPAC Name]
(3Z,17α)-3-(Méthoxyimino)-19-norprégn-4-én-20-yn-17-ol [French] [ACD/IUPAC Name]
Estr-4-en-3-one, 17-ethynyl-17-hydroxy-, O-methyloxime, (3Z,17β)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 450.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 81.8±6.0 kJ/mol
Flash Point: 226.3±31.5 °C
Index of Refraction: 1.612
Molar Refractivity: 94.9±0.5 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.45
ACD/LogD (pH 5.5): 3.87
ACD/BCF (pH 5.5): 514.01
ACD/KOC (pH 5.5): 3034.69
ACD/LogD (pH 7.4): 3.87
ACD/BCF (pH 7.4): 514.01
ACD/KOC (pH 7.4): 3034.68
Polar Surface Area: 42 Å2
Polarizability: 37.6±0.5 10-24cm3
Surface Tension: 42.6±7.0 dyne/cm
Molar Volume: 273.1±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement